2AQT
CU/ZN superoxide dismutase from neisseria meningitidis K91Q, K94Q double mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-1 |
Synchrotron site | SSRL |
Beamline | BL9-1 |
Temperature [K] | 96 |
Detector technology | IMAGE PLATE |
Collection date | 2002-03-04 |
Detector | MARRESEARCH |
Wavelength(s) | 0.95 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 98.209, 64.464, 85.051 |
Unit cell angles | 90.00, 128.33, 90.00 |
Refinement procedure
Resolution | 49.440 - 1.800 |
R-factor | 0.185 |
Rwork | 0.185 |
R-free | 0.21500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | wild-type |
RMSD bond length | 0.004 |
RMSD bond angle | 1.400 |
Data reduction software | MOSFLM |
Data scaling software | CCP4 ((SCALA)) |
Phasing software | AMoRE |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 67.000 | 1.900 |
High resolution limit [Å] | 1.800 | 1.800 |
Number of reflections | 38514 | |
<I/σ(I)> | 11.1 | 2 |
Completeness [%] | 99.5 | 99.5 |
Redundancy | 2.9 | 2.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6 | 298 | AmSO4, pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K |